پديد آورندگان :
Ati F. نويسنده , El-Aoufi S. نويسنده , Cherguic A. نويسنده , Aboul-Enein H.Y. نويسنده , Maouche B. نويسنده
چكيده لاتين :
This paper describes khellin hydrolysis mechanism using semiemperical PM3 implemented in Gaussian 03 package. The
calculations show that in the presence of an acidic media, an enolate molecular ion leads directly to ù-acetokhellinone while in
the basic media it leads to khellinone.